5-bromanyl-N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]pyridine-3-carboxamide

Systemtic Name: 5-bromanyl-N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]pyridine-3-carboxamide Openeye Name: 5-bromo-N-[4-(3-oxopiperazin-1-yl)phenyl]pyridine-3-carboxamide CAS Name: 5-bromo-N-[4-(3-oxo-1-piperazinyl)phenyl]-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-[4-(3-oxopiperazin-1-yl)phenyl]pyridine-3-carboxamide Traditional Name: 5-bromo-N-[4-(3-ketopiperazino)phenyl]nicotinamide Formula: C16H15BrN4O2 MolecularWeight: 375.2199

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=CC=C(C=C2)NC(=O)C3=CC(=CN=C3)Br

Isomeric SMILES

C1CN(CC(=O)N1)C2=CC=C(C=C2)NC(=O)C3=CC(=CN=C3)Br

InChI

InChI=1S/C16H15BrN4O2/c17-12-7-11(8-18-9-12)16(23)20-13-1-3-14(4-2-13)21-6-5-19-15(22)10-21/h1-4,7-9H,5-6,10H2,(H,19,22)(H,20,23)